1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine

C313H598N30O33 — CID 161191031

IUPAC1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine
SMILESC=C(C(C)C)N(C)CCOC(C)(C)C.CC(C)(C)OCC#CC1CC(OC(C)(C)C)C1.CC(C)(C)OCC#CCN1CC(COC(C)(C)C)C1.CC(C)C#CC1CC(ON2CCN(CCOC(C)C)CC2)C1.CC(C)CC#CC1CC(OC2CCN(CCOC(C)C)CC2)C1.CC(C)CC#CCN1CCN(CCC(C)C)CC1.CC(C)CC#CCN1CCN(CCOC(C)C)CC1.CC(C)CCCCN1CCN(CCOC(C)C)CC1.CC(C)CCOCCN1CCN(CCOC(C)C)CC1.CC(C)OC1CC(CN2CCC(OC3CC(OC(C)C)C3)CC2)C1.CC(C)OCCCN1CCN(CCCOC(C)(C)C)CC1.CC(C)OCCCc1ccc(OC2CC(OC(C)(C)C)C2)cn1.CC(C)OCCN1C2CCC1CN(CCOC(C)(C)C)C2.CC(C)OCCN1CCN(CC#CC(C)(C)C)CC1.CC(C)OCCN1CCN(CCC#CCC(C)(C)C)CC1.CC(C)OCCN1CCN(CCOC(C)C)[C@@H](C)C1.CC(C)OCCN1CCN(CCOC(C)C)[C@H](C)C1.CC(C)OCCN1C[C@H]2C[C@@H]1CN2CCOC(C)(C)C.CC(C)OCCn1cc(C(C)C(C)C)ccc1=O
InChIInChI=1S/C20H37NO3.C20H35NO2.C19H31NO3.C18H32N2O2.C18H34N2O.C17H34N2O2.C17H36N2O2.C16H32N2O2.C16H34N2O2.C16H30N2O.C16H34N2O.C16H30N2O.C16H30N2.C16H29NO2.2C15H32N2O2.C15H25NO2.C15H26O2.C12H25NO/c1-14(2)22-18-9-16(10-18)13-21-7-5-17(6-8-21)24-20-11-19(12-20)23-15(3)4;1-16(2)6-5-7-18-14-20(15-18)23-19-8-10-21(11-9-19)12-13-22-17(3)4;1-14(2)21-10-6-7-15-8-9-16(13-20-15)22-17-11-18(12-17)23-19(3,4)5;1-15(2)5-6-17-13-18(14-17)22-20-9-7-19(8-10-20)11-12-21-16(3)4;1-17(2)21-16-15-20-13-11-19(12-14-20)10-8-6-7-9-18(3,4)5;1-14(2)20-10-9-19-15-6-7-16(19)13-18(12-15)8-11-21-17(3,4)5;1-16(2)20-14-6-8-18-10-12-19(13-11-18)9-7-15-21-17(3,4)5;1-13(2)19-8-6-17-11-15-10-14(17)12-18(15)7-9-20-16(3,4)5;1-15(2)5-12-19-13-10-17-6-8-18(9-7-17)11-14-20-16(3)4;1-15(2)19-14-13-18-11-9-17(10-12-18)8-6-7-16(3,4)5;2*1-15(2)7-5-6-8-17-9-11-18(12-10-17)13-14-19-16(3)4;1-15(2)7-5-6-9-17-11-13-18(14-12-17)10-8-16(3)4;1-15(2,3)18-10-8-7-9-17-11-14(12-17)13-19-16(4,5)6;2*1-13(2)18-10-8-16-6-7-17(15(5)12-16)9-11-19-14(3)4;1-11(2)13(5)14-6-7-15(17)16(10-14)8-9-18-12(3)4;1-14(2,3)16-9-7-8-12-10-13(11-12)17-15(4,5)6;1-10(2)11(3)13(7)8-9-14-12(4,5)6/h14-20H,5-13H2,1-4H3;16-20H,6,8-15H2,1-4H3;8-9,13-14,17-18H,6-7,10-12H2,1-5H3;15-18H,7-14H2,1-4H3;17H,8-16H2,1-5H3;14-16H,6-13H2,1-5H3;16H,6-15H2,1-5H3;13-15H,6-12H2,1-5H3;15-16H,5-14H2,1-4H3;15H,8-14H2,1-5H3;15-16H,5-14H2,1-4H3;15-16H,7-14H2,1-4H3;15-16H,7-14H2,1-4H3;14H,9-13H2,1-6H3;2*13-15H,6-12H2,1-5H3;6-7,10-13H,8-9H2,1-5H3;12-13H,9-11H2,1-6H3;10H,3,8-9H2,1-2,4-7H3/t;;;;;;;14-,15-;;;;;;;2*15-;;;/m.......1......10.../s1
InChIKeyUTSMTODOHQOEMY-JEVLIYPKSA-N
MW5310.40 g/mol
LogP51.13
Rot. Bonds126

About 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine

1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine (PubChem CID 161191031) has the molecular formula C313H598N30O33 and a molecular weight of 5310.40 g/mol. Its IUPAC name is 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine.

Molecular Properties

Compound Name1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine
PubChem CID161191031
Molecular FormulaC313H598N30O33
Molecular Weight5310.40 g/mol
Exact Mass5306.60
IUPAC Name1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine
SMILESC=C(C(C)C)N(C)CCOC(C)(C)C.CC(C)(C)OCC#CC1CC(OC(C)(C)C)C1.CC(C)(C)OCC#CCN1CC(COC(C)(C)C)C1.CC(C)C#CC1CC(ON2CCN(CCOC(C)C)CC2)C1.CC(C)CC#CC1CC(OC2CCN(CCOC(C)C)CC2)C1.CC(C)CC#CCN1CCN(CCC(C)C)CC1.CC(C)CC#CCN1CCN(CCOC(C)C)CC1.CC(C)CCCCN1CCN(CCOC(C)C)CC1.CC(C)CCOCCN1CCN(CCOC(C)C)CC1.CC(C)OC1CC(CN2CCC(OC3CC(OC(C)C)C3)CC2)C1.CC(C)OCCCN1CCN(CCCOC(C)(C)C)CC1.CC(C)OCCCc1ccc(OC2CC(OC(C)(C)C)C2)cn1.CC(C)OCCN1C2CCC1CN(CCOC(C)(C)C)C2.CC(C)OCCN1CCN(CC#CC(C)(C)C)CC1.CC(C)OCCN1CCN(CCC#CCC(C)(C)C)CC1.CC(C)OCCN1CCN(CCOC(C)C)[C@@H](C)C1.CC(C)OCCN1CCN(CCOC(C)C)[C@H](C)C1.CC(C)OCCN1C[C@H]2C[C@@H]1CN2CCOC(C)(C)C.CC(C)OCCn1cc(C(C)C(C)C)ccc1=O
InChIInChI=1S/C20H37NO3.C20H35NO2.C19H31NO3.C18H32N2O2.C18H34N2O.C17H34N2O2.C17H36N2O2.C16H32N2O2.C16H34N2O2.C16H30N2O.C16H34N2O.C16H30N2O.C16H30N2.C16H29NO2.2C15H32N2O2.C15H25NO2.C15H26O2.C12H25NO/c1-14(2)22-18-9-16(10-18)13-21-7-5-17(6-8-21)24-20-11-19(12-20)23-15(3)4;1-16(2)6-5-7-18-14-20(15-18)23-19-8-10-21(11-9-19)12-13-22-17(3)4;1-14(2)21-10-6-7-15-8-9-16(13-20-15)22-17-11-18(12-17)23-19(3,4)5;1-15(2)5-6-17-13-18(14-17)22-20-9-7-19(8-10-20)11-12-21-16(3)4;1-17(2)21-16-15-20-13-11-19(12-14-20)10-8-6-7-9-18(3,4)5;1-14(2)20-10-9-19-15-6-7-16(19)13-18(12-15)8-11-21-17(3,4)5;1-16(2)20-14-6-8-18-10-12-19(13-11-18)9-7-15-21-17(3,4)5;1-13(2)19-8-6-17-11-15-10-14(17)12-18(15)7-9-20-16(3,4)5;1-15(2)5-12-19-13-10-17-6-8-18(9-7-17)11-14-20-16(3)4;1-15(2)19-14-13-18-11-9-17(10-12-18)8-6-7-16(3,4)5;2*1-15(2)7-5-6-8-17-9-11-18(12-10-17)13-14-19-16(3)4;1-15(2)7-5-6-9-17-11-13-18(14-12-17)10-8-16(3)4;1-15(2,3)18-10-8-7-9-17-11-14(12-17)13-19-16(4,5)6;2*1-13(2)18-10-8-16-6-7-17(15(5)12-16)9-11-19-14(3)4;1-11(2)13(5)14-6-7-15(17)16(10-14)8-9-18-12(3)4;1-14(2,3)16-9-7-8-12-10-13(11-12)17-15(4,5)6;1-10(2)11(3)13(7)8-9-14-12(4,5)6/h14-20H,5-13H2,1-4H3;16-20H,6,8-15H2,1-4H3;8-9,13-14,17-18H,6-7,10-12H2,1-5H3;15-18H,7-14H2,1-4H3;17H,8-16H2,1-5H3;14-16H,6-13H2,1-5H3;16H,6-15H2,1-5H3;13-15H,6-12H2,1-5H3;15-16H,5-14H2,1-4H3;15H,8-14H2,1-5H3;15-16H,5-14H2,1-4H3;15-16H,7-14H2,1-4H3;15-16H,7-14H2,1-4H3;14H,9-13H2,1-6H3;2*13-15H,6-12H2,1-5H3;6-7,10-13H,8-9H2,1-5H3;12-13H,9-11H2,1-6H3;10H,3,8-9H2,1-2,4-7H3/t;;;;;;;14-,15-;;;;;;;2*15-;;;/m.......1......10.../s1
InChIKeyUTSMTODOHQOEMY-JEVLIYPKSA-N
XLogP51.13
TPSA420.97 Ų
H-Bond Donors
H-Bond Acceptors63
Rotatable Bonds126
Heavy Atoms376
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005310.40
LogP ≤ 551.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1063

Analyze 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine with MolForge

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Related Compounds

3,6-bis[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,6-diazabicyclo[3.1.1]heptane;1-[4-(3,3-dimethylbutan-2-yl)cyclohexyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-[[4-(3,3-dimethylbutan-2-yl)phenyl]methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-[2-[3-(3,3-dimethylbutoxy)cyclobutyl]oxyethyl]-4-(3-methylbutyl)piperazine;1-[2-[3-(3,3-dimethylbutoxy)cyclobutyl]oxyethyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-(6-methylhept-1-ynyl)-5-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]pyridine;2-[(E)-4-methylpent-1-enyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;1-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;5-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyridine;5-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]-2-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]pyrimidine;5-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]-2-(4-propan-2-yloxybut-1-ynyl)pyridine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[(E)-3-propan-2-yloxyprop-1-enyl]pyridine
CID 167605421
1-[3-(1-tert-butylazetidin-3-yl)oxypropyl]-4-(4,4-dimethylpent-2-ynyl)piperazine;2-[3-(1-tert-butylazetidin-3-yl)oxypropyl]-5-[3-[(2-methylpropan-2-yl)oxy]propoxy]pyridine;1-tert-butyl-3-[2-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethoxy]propyl]azetidine;1-tert-butyl-3-[2-[3-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethyl]cyclobutyl]ethoxy]azetidine;1-tert-butyl-3-[2-[3-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxymethyl]cyclobutyl]oxyethoxy]azetidine;1-tert-butyl-3-[3-[[3-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxymethyl]oxetan-3-yl]methoxy]propoxy]azetidine;1-tert-butyl-4-[3-[5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-pyridinyl]propyl]piperazine;1-tert-butyl-4-[5-[5-[(2-methylpropan-2-yl)oxy]pentoxy]pentyl]piperidine;1-tert-butyl-3-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]azetidine
CID 158833662
(1R,4R)-2-(3,3-dimethylbutyl)-5-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2,5-diazabicyclo[2.2.1]heptane;(1S,4S)-2-(3,3-dimethylbutyl)-5-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2,5-diazabicyclo[2.2.1]heptane;8-(3,3-dimethylbutyl)-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,8-diazabicyclo[3.2.1]octane;(2R)-1-(3,3-dimethylbutyl)-2-methyl-4-(2-propan-2-yloxyethyl)piperazine;(2S)-1-(3,3-dimethylbutyl)-2-methyl-4-(2-propan-2-yloxyethyl)piperazine;(2R)-4-(3,3-dimethylbutyl)-2-methyl-1-(2-propan-2-yloxyethyl)piperazine;(2S)-4-(3,3-dimethylbutyl)-2-methyl-1-(2-propan-2-yloxyethyl)piperazine;3-(3,3-dimethylbutyl)-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-(4,4-dimethylpentyl)-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;methane
CID 157308957
6-tert-butyl-2-[2,2-difluoro-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybutoxy]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-6-[2,2-difluoro-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypentyl]-2,6-diazaspiro[3.3]heptane;1-tert-butyl-3-[2-[2-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyethoxy]propyl]azetidine;1-tert-butyl-4-[3-[5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-pyridinyl]propyl]piperazine;2-[4-(1-tert-butylpiperidin-4-yl)oxybut-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;1-tert-butyl-4-[3,3,3-trifluoro-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propyl]piperidine;2,2-difluoro-3,3-dimethyl-1-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]butane;1-[2,2-difluoro-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine;1-[2,2-difluoro-5-[(2-methylpropan-2-yl)oxy]pentyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine;2-[3-(3,3-dimethylbut-1-ynoxy)propyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;2-[4-(2,2-dimethylpropoxy)but-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;4-isocyano-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclopropyl]ethynyl]pyridine;1-[(2-methylpropan-2-yl)oxy]-3-[[3-[3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]prop-1-ynyl]cyclobutyl]methoxy]cyclobutane
CID 161497697
3,6-bis(2-propan-2-yloxyethyl)-3,6-diazabicyclo[3.1.1]heptane;1-[4-(3,3-dimethylbutan-2-yl)phenyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-[2-[3-(3,3-dimethylbutoxy)cyclobutyl]oxyethyl]-4-(3-methylbutyl)piperazine;1-[2-[3-(3,3-dimethylbutoxy)cyclobutyl]oxyethyl]-4-(2-propan-2-yloxyethyl)piperazine;2-(3,3-dimethylbutoxy)-7-(2-propan-2-yloxyethyl)-7-azaspiro[3.5]nonane;2-[(E)-4,4-dimethylpent-1-enyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyrimidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[(E)-3-propan-2-yloxyprop-1-enyl]pyridine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[(E)-3-propan-2-yloxyprop-1-enyl]pyrimidine;1-[2-(3-propan-2-yloxycyclobutyl)oxyethyl]-4-(2-propan-2-yloxyethyl)piperazine
CID 158739383
N-tert-butyl-N-methyl-2-[3-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyphenyl]prop-2-ynoxy]acetamide;1-tert-butyl-4-[3-[5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-pyridinyl]prop-2-ynyl]piperazine;1-[4-[(2-methylpropan-2-yl)oxy]but-1-ynyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybenzene;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybut-1-ynyl]pyridine;1-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-4-[4-(3-propan-2-yloxypropoxy)but-1-ynyl]benzene;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[4-(3-propan-2-yloxypropoxy)but-1-ynyl]pyridine
CID 158598467
2-tert-butyl-6-[2,2-difluoro-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybutoxy]-2-azaspiro[3.3]heptane;2-tert-butyl-6-[2,2-difluoro-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypentyl]-2,6-diazaspiro[3.3]heptane;1-tert-butyl-4-[3,3,3-trifluoro-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propyl]piperidine;2,2-difluoro-3,3-dimethyl-1-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]propoxy]butane;1-[2,2-difluoro-5-[(2-methylpropan-2-yl)oxy]pentyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine;2-[3-(3,3-dimethylbut-1-ynoxy)propyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;2-[4-(2,2-dimethylpropoxy)but-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;1-[3-(2-ethoxyethoxy)-2,2-difluoropropyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine;4-isocyano-2-[3-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]but-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclopropyl]ethynyl]pyridine;1-[(2-methylpropan-2-yl)oxy]-3-[[3-[3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]prop-1-ynyl]cyclobutyl]methoxy]cyclobutane;propane
CID 158718748
2-[4-(1-tert-butylazetidin-3-yl)oxybutyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;2-[4-(3-tert-butylcyclobutyl)oxybut-1-ynyl]-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypyridine;N-tert-butyl-N-methyl-2-[3-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyphenyl]prop-2-ynoxy]acetamide;1-tert-butyl-4-[3-[5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-pyridinyl]prop-2-ynyl]piperazine;4-isocyano-5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[4-[3-[(2-methylpropan-2-yl)oxy]propoxy]but-1-ynyl]pyridine;1-[4-[(2-methylpropan-2-yl)oxy]but-1-ynyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybenzene;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybut-1-ynyl]pyridine;1-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-4-[4-[3-[(2-methylpropan-2-yl)oxy]propoxy]but-1-ynyl]benzene;3-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-6-[3-[(2-methylpropan-2-yl)oxy]propyl]pyridazine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrimidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[4-(3-propan-2-yloxypropoxy)but-1-ynyl]pyridine
CID 159121579
N-tert-butyl-N-methyl-2-[3-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyphenyl]prop-2-ynoxy]acetamide;1-tert-butyl-4-[3-[5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-pyridinyl]prop-2-ynyl]piperazine;1-[4-[(2-methylpropan-2-yl)oxy]but-1-ynyl]-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxybenzene;bis(1-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-4-[4-[3-[(2-methylpropan-2-yl)oxy]propoxy]but-1-ynyl]benzene);5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrimidine
CID 158815357
1-[3-[1-[3-(tert-butylamino)propyl]piperidin-4-yl]oxycyclobutyl]-3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propan-2-one;(1S,4S)-2-[2-(2,2-dimethylpropoxy)ethyl]-5-[2-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethoxy]ethyl]-2,5-diazabicyclo[2.2.1]heptane;1-[3-[1-[3-(2,2-dimethylpropoxy)propyl]piperidin-4-yl]oxycyclobutyl]-3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propan-2-one;N-[2-[2-[(1S,4S)-5-[2-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethoxy]ethyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]ethoxy]ethyl]-2-methylpropan-2-amine;(1S,4S)-2-[2-[2-[4-(2-methoxyethyl)piperazin-1-yl]ethoxy]ethyl]-5-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2,5-diazabicyclo[2.2.1]heptane;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]-3-[3-[1-[3-[(2-methylpropan-2-yl)oxy]propyl]piperidin-4-yl]oxycyclobutyl]propan-2-one
CID 157165964
1-tert-butyl-4-(3,3-dimethylbutyl)piperazine;1-tert-butyl-4-[6-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxyhexyl]piperazine;1-tert-butyl-3-[5-[5-[(2-methylpropan-2-yl)oxy]pentoxy]pentoxy]azetidine;1-tert-butyl-4-[5-[5-[(2-methylpropan-2-yl)oxy]pentoxy]pentyl]piperidine;1-tert-butyl-4-[3,3,3-trifluoro-2-[2-[5-[(2-methylpropan-2-yl)oxy]pentoxy]ethoxy]propyl]piperidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-[5-[(2-methylpropan-2-yl)oxy]pent-1-ynyl]pyridine;1-[(2-methylpropan-2-yl)oxy]-3-[5-[5-[(2-methylpropan-2-yl)oxy]pentoxy]pentoxy]azetidine;3-[(2-methylpropan-2-yl)oxy]-1-[5-[5-[(2-methylpropan-2-yl)oxy]pentoxy]pentyl]azetidine
CID 167558982
4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[6-[(2-methylpropan-2-yl)oxy]hex-4-ynyl]piperidine
CID 134488993

Frequently Asked Questions

What is the IUPAC name of 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine?
The IUPAC name of 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine (CID 161191031) is 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine.
What is the SMILES notation for 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine?
The canonical SMILES for 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine is C=C(C(C)C)N(C)CCOC(C)(C)C.CC(C)(C)OCC#CC1CC(OC(C)(C)C)C1.CC(C)(C)OCC#CCN1CC(COC(C)(C)C)C1.CC(C)C#CC1CC(ON2CCN(CCOC(C)C)CC2)C1.CC(C)CC#CC1CC(OC2CCN(CCOC(C)C)CC2)C1.CC(C)CC#CCN1CCN(CCC(C)C)CC1.CC(C)CC#CCN1CCN(CCOC(C)C)CC1.CC(C)CCCCN1CCN(CCOC(C)C)CC1.CC(C)CCOCCN1CCN(CCOC(C)C)CC1.CC(C)OC1CC(CN2CCC(OC3CC(OC(C)C)C3)CC2)C1.CC(C)OCCCN1CCN(CCCOC(C)(C)C)CC1.CC(C)OCCCc1ccc(OC2CC(OC(C)(C)C)C2)cn1.CC(C)OCCN1C2CCC1CN(CCOC(C)(C)C)C2.CC(C)OCCN1CCN(CC#CC(C)(C)C)CC1.CC(C)OCCN1CCN(CCC#CCC(C)(C)C)CC1.CC(C)OCCN1CCN(CCOC(C)C)[C@@H](C)C1.CC(C)OCCN1CCN(CCOC(C)C)[C@H](C)C1.CC(C)OCCN1C[C@H]2C[C@@H]1CN2CCOC(C)(C)C.CC(C)OCCn1cc(C(C)C(C)C)ccc1=O.
What is the InChIKey of 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine?
The InChIKey is UTSMTODOHQOEMY-JEVLIYPKSA-N. The full InChI is InChI=1S/C20H37NO3.C20H35NO2.C19H31NO3.C18H32N2O2.C18H34N2O.C17H34N2O2.C17H36N2O2.C16H32N2O2.C16H34N2O2.C16H30N2O.C16H34N2O.C16H30N2O.C16H30N2.C16H29NO2.2C15H32N2O2.C15H25NO2.C15H26O2.C12H25NO/c1-14(2)22-18-9-16(10-18)13-21-7-5-17(6-8-21)24-20-11-19(12-20)23-15(3)4;1-16(2)6-5-7-18-14-20(15-18)23-19-8-10-21(11-9-19)12-13-22-17(3)4;1-14(2)21-10-6-7-15-8-9-16(13-20-15)22-17-11-18(12-17)23-19(3,4)5;1-15(2)5-6-17-13-18(14-17)22-20-9-7-19(8-10-20)11-12-21-16(3)4;1-17(2)21-16-15-20-13-11-19(12-14-20)10-8-6-7-9-18(3,4)5;1-14(2)20-10-9-19-15-6-7-16(19)13-18(12-15)8-11-21-17(3,4)5;1-16(2)20-14-6-8-18-10-12-19(13-11-18)9-7-15-21-17(3,4)5;1-13(2)19-8-6-17-11-15-10-14(17)12-18(15)7-9-20-16(3,4)5;1-15(2)5-12-19-13-10-17-6-8-18(9-7-17)11-14-20-16(3)4;1-15(2)19-14-13-18-11-9-17(10-12-18)8-6-7-16(3,4)5;2*1-15(2)7-5-6-8-17-9-11-18(12-10-17)13-14-19-16(3)4;1-15(2)7-5-6-9-17-11-13-18(14-12-17)10-8-16(3)4;1-15(2,3)18-10-8-7-9-17-11-14(12-17)13-19-16(4,5)6;2*1-13(2)18-10-8-16-6-7-17(15(5)12-16)9-11-19-14(3)4;1-11(2)13(5)14-6-7-15(17)16(10-14)8-9-18-12(3)4;1-14(2,3)16-9-7-8-12-10-13(11-12)17-15(4,5)6;1-10(2)11(3)13(7)8-9-14-12(4,5)6/h14-20H,5-13H2,1-4H3;16-20H,6,8-15H2,1-4H3;8-9,13-14,17-18H,6-7,10-12H2,1-5H3;15-18H,7-14H2,1-4H3;17H,8-16H2,1-5H3;14-16H,6-13H2,1-5H3;16H,6-15H2,1-5H3;13-15H,6-12H2,1-5H3;15-16H,5-14H2,1-4H3;15H,8-14H2,1-5H3;15-16H,5-14H2,1-4H3;15-16H,7-14H2,1-4H3;15-16H,7-14H2,1-4H3;14H,9-13H2,1-6H3;2*13-15H,6-12H2,1-5H3;6-7,10-13H,8-9H2,1-5H3;12-13H,9-11H2,1-6H3;10H,3,8-9H2,1-2,4-7H3/t;;;;;;;14-,15-;;;;;;;2*15-;;;/m.......1......10.../s1.
What are the key properties of 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine?
1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine has a molecular weight of 5310.40 g/mol, XLogP of 51.13, 126 rotatable bonds, 0 hydrogen bond donors, and 63 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,6-dimethylhept-3-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;N,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]but-1-en-2-amine;1-(4,4-dimethylpent-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;(2R)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;(2S)-2-methyl-1,4-bis(2-propan-2-yloxyethyl)piperazine;5-(3-methylbutan-2-yl)-1-(2-propan-2-yloxyethyl)pyridin-2-one;1-[2-(3-methylbutoxy)ethyl]-4-(2-propan-2-yloxyethyl)piperazine;1-(3-methylbutyl)-4-(5-methylhex-2-ynyl)piperazine;1-[3-(3-methylbut-1-ynyl)cyclobutyl]oxy-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhexyl)-4-(2-propan-2-yloxyethyl)piperazine;1-(5-methylhex-2-ynyl)-4-(2-propan-2-yloxyethyl)piperazine;4-[3-(4-methylpent-1-ynyl)cyclobutyl]oxy-1-(2-propan-2-yloxyethyl)piperidine;1-[4-[(2-methylpropan-2-yl)oxy]but-2-ynyl]-3-[(2-methylpropan-2-yl)oxymethyl]azetidine;5-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-2-(3-propan-2-yloxypropyl)pyridine;(1R,4R)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]-5-(2-propan-2-yloxyethyl)-2,5-diazabicyclo[2.2.1]heptane;3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-8-(2-propan-2-yloxyethyl)-3,8-diazabicyclo[3.2.1]octane;1-[(2-methylpropan-2-yl)oxy]-3-[3-[(2-methylpropan-2-yl)oxy]prop-1-ynyl]cyclobutane;1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-(3-propan-2-yloxypropyl)piperazine;1-[(3-propan-2-yloxycyclobutyl)methyl]-4-(3-propan-2-yloxycyclobutyl)oxypiperidine is sourced from PubChem (CID 161191031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).